2-Phenoxy-Ethanimidamide Hydrochloride - ≥95% , CAS No.67386-38-3

CAS: 67386-38-3 Cat. No.: B301361 Summenformel: C₈H₁₁ClN₂O Molekulargewicht: 186.64 EG-Nummer: 672-867-9

GRADE & PURITY ≥95%

Synonyms

NSC338192 | phenoxyacetamidine hydrochloride | Su-176 | 2-Phenoxyacetamidine Hydrochloride | 2-Phenoxyacetamidine, HCl | NIOSH/AD1047000 | AC-7102 | 2-PHENOXYACETAMIDINE HCL | 2-phenoxyethanimidamide;hydrochloride | EN300-55058 | Ethanimidamide,2-phenoxy-

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

NSC338192 | phenoxyacetamidine hydrochloride | Su-176 | 2-Phenoxyacetamidine Hydrochloride | 2-Phenoxyacetamidine, HCl | NIOSH/AD1047000 | AC-7102 | 2-PHENOXYACETAMIDINE HCL | 2-phenoxyethanimidamide;hydrochloride | EN300-55058 | Ethanimidamide,2-phenoxy-

Spezifikationen & Reinheit

≥95%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

488192947

Kanonisches Lächeln

C1=CC=C(C=C1)OCC(=N)N.Cl

IUPAC Name

2-phenoxyethanimidamide;hydrochloride

InChIKey

ZLZLLGGMCNVVAS-UHFFFAOYSA-N

INCHI

1S/C8H10N2O.ClH/c9-8(10)6-11-7-4-2-1-3-5-7;/h1-5H,6H2,(H3,9,10);1H

Isomere SMILES

C1=CC=C(C=C1)OCC(=N)N.Cl

Molekulargewicht

186.64

Reaxy-Rn

3703357

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3703357&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Alkyl aryl ethers Carboximidamides Carboxamidines Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Amidine - Carboxylic acid amidine - Ether - Carboximidamide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Hydrochloride - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Molekulargewicht: 186.640 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 186.056 Da
• Monoisotopic Mass: 186.056 Da
• Topological Polar Surface Area: 59.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 130.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Häufig gestellte Fragen

How should this product be stored?

Store at room temperature.

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 67386-38-3, the molecular formula is C8H11ClN2O, and the molecular weight is 186.64 g/mol. InChIKey ZLZLLGGMCNVVAS-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.